N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-methyl-N-[2-(3-methylphenoxy)ethyl]acetamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN(C)C(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCN(C)C(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c1-14-4-3-5-16(10-14)28-9-8-21(2)19(24)12-22-17-11-15(23(26)27)6-7-18(17)29-13-20(22)25/h3-7,10-11H,8-9,12-13H2,1-2H3